U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H23N3O4.H2O
Molecular Weight 315.3654
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NYX-2925 MONOHYDRATE

SMILES

O.C[C@@H](O)[C@H](N1C[C@]2(CCCN2C(=O)C(C)C)C1=O)C(N)=O

InChI

InChIKey=CFAQSXSFIBPHCJ-QTFRNQDKSA-N
InChI=1S/C14H23N3O4.H2O/c1-8(2)12(20)17-6-4-5-14(17)7-16(13(14)21)10(9(3)18)11(15)19;/h8-10,18H,4-7H2,1-3H3,(H2,15,19);1H2/t9-,10+,14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C14H23N3O4
Molecular Weight 297.3501
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:38:27 GMT 2023
Edited
by admin
on Sat Dec 16 11:38:27 GMT 2023
Record UNII
24Z9J3L63U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NYX-2925 MONOHYDRATE
Common Name English
(2S,3R)-3-HYDROXY-2-((R)-5-ISOBUTYRYL-1-OXO-2,5-DIAZASPIRO(3.4)OCTAN-2YL)BUTANAMIDE MONOHYDRATE
Systematic Name English
Code System Code Type Description
CAS
2641992-17-6
Created by admin on Sat Dec 16 11:38:27 GMT 2023 , Edited by admin on Sat Dec 16 11:38:27 GMT 2023
PRIMARY
PUBCHEM
163203537
Created by admin on Sat Dec 16 11:38:27 GMT 2023 , Edited by admin on Sat Dec 16 11:38:27 GMT 2023
PRIMARY
FDA UNII
24Z9J3L63U
Created by admin on Sat Dec 16 11:38:27 GMT 2023 , Edited by admin on Sat Dec 16 11:38:27 GMT 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE
Related Record Type Details
ACTIVE MOIETY